>compound Pentachlorophenol_Pentachlorophenol
#instrument UPLC Q-Tof Premier, Waters
>formula C6HCl5O
#smiles Oc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1
#RECORD LC-ESI-QTOF_train_data/PR100511.txt
>charge -1
>ionization [M-H]-
>parentmass 262.8392

>collision 5-60
262.8392 959.5

